P-Xylene

P-Xylene

SCHEMBL31577563

C#N.C#N.Cc1ccc(C)cc1

nearest known ligand 0.73

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 6/20 0.73
▸ TDP1 Q9NUW8 1/20 0.73
▸ ALDH1A1 P00352 4/20 0.50
▸ CYP2A6 P11509 3/20 0.50
▸ CA2 P00918 2/20 0.50
▸ CA1 P00915 1/20 0.50
▸ CA7 P43166 1/20 0.50
▸ CA9 Q16790 1/20 0.50
▸ TSHR P16473 3/20 0.47
▸ LMNA P02545 2/20 0.47
▸ ALOX12 P18054 1/20 0.47
▸ IDO1 P14902 1/20 0.42
▸ CES2 O00748 1/20 0.42
▸ CES1 P23141 1/20 0.42
▸ LPL P06858 1/20 0.42
▸ LIPG Q9Y5X9 1/20 0.42
▸ ORAI1 Q96D31 1/20 0.42
▸ ORAI2 Q96SN7 1/20 0.42
▸ ORAI3 Q9BRQ5 1/20 0.42
▸ TRPV6 Q9H1D0 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
P-Xylene SCHEMBL27447774 1.00 ACHE (0.73) ACHETDP1ALDH1A1CYP2A6CA2
P-Xylene SCHEMBL771 0.85 — —
P-Xylene SCHEMBL11772917 0.85 ACHE (1.00) ACHETDP1ALDH1A1CYP2A6CA2
P-Xylene SCHEMBL11770184 0.85 ACHE (1.00) ACHETDP1ALDH1A1CYP2A6CA2
P-Xylene SCHEMBL460348 0.85 ACHE (1.00) ACHETDP1ALDH1A1CYP2A6CA2
Cyanide SCHEMBL9501307 0.83 ACHE (0.50) ACHETDP1ALDH1A1CYP2A6CA2
Toluene SCHEMBL5420405 0.81 — —
Toluene SCHEMBL2189089 0.81 ACHE (0.79) ACHETDP1ALDH1A1CYP2A6CA2
P-Xylene SCHEMBL6460147 0.80 — —
P-Xylene SCHEMBL2294575 0.80 ACHE (0.89) ACHETDP1ALDH1A1CYP2A6CA2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025106715-A1 CONJUGATED POLYMERS OR POLYMER DOTS AS FLUORESCENT LABELS ILLUMINA, INC. (US) 2025-05-22 — — WO disclosed
US-20250163505-A1 CONJUGATED POLYMERS OR POLYMER DOTS AS FLUORESCENT LABELS ILLUMINA, INC. 2025-05-22 — — US disclosed
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